methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate

C8H16N2O5S — CID 114464182

IUPACmethyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate
SMILESCOC(=O)NS(=O)(=O)NC1(CO)CCCC1
InChIInChI=1S/C8H16N2O5S/c1-15-7(12)9-16(13,14)10-8(6-11)4-2-3-5-8/h10-11H,2-6H2,1H3,(H,9,12)
InChIKeyCLBUVCLSMXUFKX-UHFFFAOYSA-N
MW252.29 g/mol
LogP-0.52
Rot. Bonds4

About methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate

methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate (PubChem CID 114464182) has the molecular formula C8H16N2O5S and a molecular weight of 252.29 g/mol. Its IUPAC name is methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate.

Molecular Properties

Compound Namemethyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate
PubChem CID114464182
Molecular FormulaC8H16N2O5S
Molecular Weight252.29 g/mol
Exact Mass252.08
IUPAC Namemethyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate
SMILESCOC(=O)NS(=O)(=O)NC1(CO)CCCC1
InChIInChI=1S/C8H16N2O5S/c1-15-7(12)9-16(13,14)10-8(6-11)4-2-3-5-8/h10-11H,2-6H2,1H3,(H,9,12)
InChIKeyCLBUVCLSMXUFKX-UHFFFAOYSA-N
XLogP-0.52
TPSA104.73 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

methyl N-[[1-(chloromethyl)cyclobutyl]sulfamoyl]carbamate
CID 114466954
methyl N-[[1-(bromomethyl)cyclobutyl]sulfamoyl]carbamate
CID 114466957
2-[1-(ethoxycarbonylsulfamoylamino)cyclopentyl]acetic acid
CID 114462754
N-[1-(hydroxymethyl)cyclopentyl]methanesulfonamide
CID 62520336
N-[1-(hydroxymethyl)cyclohexyl]-2-methoxyethanesulfonamide
CID 62520965
ethyl N-[[1-(hydroxymethyl)-4-methylcyclohexyl]sulfamoyl]carbamate
CID 114464188
ethyl N-[[1-(chloromethyl)cyclohexyl]sulfamoyl]carbamate
CID 114466410
1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane
CID 62521242
1-(methoxycarbonylsulfamoylamino)-2-methylcyclohexane-1-carboxylic acid
CID 114462405
1,1-difluoro-N-[1-(hydroxymethyl)cyclohexyl]methanesulfonamide
CID 62520783
4-[[1-(hydroxymethyl)cyclohexyl]sulfamoyl]butanoic acid
CID 62552006
methyl N-[1-(aminomethyl)cyclohexyl]carbamate
CID 63765596

Frequently Asked Questions

What is the IUPAC name of methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate?
The IUPAC name of methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate (CID 114464182) is methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate.
What is the SMILES notation for methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate?
The canonical SMILES for methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate is COC(=O)NS(=O)(=O)NC1(CO)CCCC1.
What is the InChIKey of methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate?
The InChIKey is CLBUVCLSMXUFKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O5S/c1-15-7(12)9-16(13,14)10-8(6-11)4-2-3-5-8/h10-11H,2-6H2,1H3,(H,9,12).
What are the key properties of methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate?
methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate has a molecular weight of 252.29 g/mol, XLogP of -0.52, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]carbamate is sourced from PubChem (CID 114464182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).